Matches in SemOpenAlex for { <https://semopenalex.org/work/W2016806812> ?p ?o ?g. }
- W2016806812 endingPage "8487" @default.
- W2016806812 startingPage "8480" @default.
- W2016806812 abstract "Stabilizing effects in oxygenated thiane- and 1,3-dithiane-derived α-carbanions were investigated computationally. All isomers bearing sulfide, sulfoxide, and sulfone functional groups and combinations thereof were investigated by DFT calculations and NBO analyses. Their stabilities and the stereoelectronic effects present in these compounds were compared. Stabilizing effects of the respective functional groups were further estimated by calculation of isodesmic reactions. It turned out that nC → σ*S−O interactions, where both the nC and the S═O bond are in an antiperiplanar conformation, have the highest stabilizing effects. Similar stabilizing interactions are effective in carbanions with an equatorial lone pair at the carbon; here a productive nC → σ*S−C interaction is possible. nC → σ*S−O interactions, where the S═O bond is part of a sulfoxide are significantly more effective than in sulfones. Calculations of isodesmic reactions show similar trends but suggest the presence of additional electrostatic effects and possibly, to some extent, steric effects." @default.
- W2016806812 created "2016-06-24" @default.
- W2016806812 creator A5067219980 @default.
- W2016806812 date "2010-07-27" @default.
- W2016806812 modified "2023-10-09" @default.
- W2016806812 title "Stereoelectronic Effects in α-Carbanions of Conformationally Constrained Sulfides, Sulfoxides, and Sulfones" @default.
- W2016806812 cites W169343100 @default.
- W2016806812 cites W1967397491 @default.
- W2016806812 cites W1971661284 @default.
- W2016806812 cites W1977848164 @default.
- W2016806812 cites W1979204567 @default.
- W2016806812 cites W1982371445 @default.
- W2016806812 cites W1985211154 @default.
- W2016806812 cites W1987816816 @default.
- W2016806812 cites W1991895224 @default.
- W2016806812 cites W1996973796 @default.
- W2016806812 cites W1997118097 @default.
- W2016806812 cites W1997501976 @default.
- W2016806812 cites W2002194503 @default.
- W2016806812 cites W2005888980 @default.
- W2016806812 cites W2011304683 @default.
- W2016806812 cites W2012900427 @default.
- W2016806812 cites W2016061836 @default.
- W2016806812 cites W2020112314 @default.
- W2016806812 cites W2021958377 @default.
- W2016806812 cites W2023271753 @default.
- W2016806812 cites W2027161744 @default.
- W2016806812 cites W2033990154 @default.
- W2016806812 cites W2033997871 @default.
- W2016806812 cites W2034258862 @default.
- W2016806812 cites W2037815581 @default.
- W2016806812 cites W2038082911 @default.
- W2016806812 cites W2038767330 @default.
- W2016806812 cites W2039559098 @default.
- W2016806812 cites W2046360548 @default.
- W2016806812 cites W2047047117 @default.
- W2016806812 cites W2051146701 @default.
- W2016806812 cites W2055563809 @default.
- W2016806812 cites W2056444626 @default.
- W2016806812 cites W2057241065 @default.
- W2016806812 cites W2058410868 @default.
- W2016806812 cites W2058848030 @default.
- W2016806812 cites W2059463192 @default.
- W2016806812 cites W2065619311 @default.
- W2016806812 cites W2066103357 @default.
- W2016806812 cites W2068802714 @default.
- W2016806812 cites W2071137944 @default.
- W2016806812 cites W2071299413 @default.
- W2016806812 cites W2071583099 @default.
- W2016806812 cites W2077343851 @default.
- W2016806812 cites W2078631380 @default.
- W2016806812 cites W2083986598 @default.
- W2016806812 cites W2086713235 @default.
- W2016806812 cites W2087719995 @default.
- W2016806812 cites W2093771392 @default.
- W2016806812 cites W2108143480 @default.
- W2016806812 cites W2108707859 @default.
- W2016806812 cites W2118051944 @default.
- W2016806812 cites W2129579634 @default.
- W2016806812 cites W2137736465 @default.
- W2016806812 cites W2141434017 @default.
- W2016806812 cites W2143981217 @default.
- W2016806812 cites W2147798444 @default.
- W2016806812 cites W2151469115 @default.
- W2016806812 cites W2164318957 @default.
- W2016806812 cites W2165418130 @default.
- W2016806812 cites W2167426231 @default.
- W2016806812 cites W2169818329 @default.
- W2016806812 cites W2172169578 @default.
- W2016806812 cites W2316137157 @default.
- W2016806812 cites W2332127237 @default.
- W2016806812 cites W2949067485 @default.
- W2016806812 cites W2949971630 @default.
- W2016806812 cites W2950255456 @default.
- W2016806812 cites W2950911587 @default.
- W2016806812 cites W3005141863 @default.
- W2016806812 cites W4293033195 @default.
- W2016806812 cites W607406955 @default.
- W2016806812 doi "https://doi.org/10.1021/jp1063758" @default.
- W2016806812 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/20701357" @default.
- W2016806812 hasPublicationYear "2010" @default.
- W2016806812 type Work @default.
- W2016806812 sameAs 2016806812 @default.
- W2016806812 citedByCount "29" @default.
- W2016806812 countsByYear W20168068122012 @default.
- W2016806812 countsByYear W20168068122013 @default.
- W2016806812 countsByYear W20168068122014 @default.
- W2016806812 countsByYear W20168068122015 @default.
- W2016806812 countsByYear W20168068122016 @default.
- W2016806812 countsByYear W20168068122017 @default.
- W2016806812 countsByYear W20168068122018 @default.
- W2016806812 countsByYear W20168068122019 @default.
- W2016806812 countsByYear W20168068122020 @default.
- W2016806812 countsByYear W20168068122021 @default.
- W2016806812 countsByYear W20168068122022 @default.
- W2016806812 crossrefType "journal-article" @default.
- W2016806812 hasAuthorship W2016806812A5067219980 @default.
- W2016806812 hasConcept C130188946 @default.